Vitas-M small molecule compound
2-[(4-methyl-3-nitrophenyl)carbonyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]hydrazinecarbothioamide
Catalog ID
STK458428
SMILES S=C(Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1)NNC(=O)c1ccc(c(c1)[N+](=O)[O-])C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H17N7O5S2 MW 487.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N7O5S2/c1-12-3-4-13(11-16(12)26(28)29)17(27)23-24-19(32)22-14-5-7-15(8-6-14)33(30,31)25-18-20-9-2-10-21-18/h2-11H,1H3,(H,23,27)(H,20,21,25)(H2,22,24,32)InChIKey
SNKGQKMJLSJHEW-UHFFFAOYSA-NSynonyms
(4METHYL3NITROPHENYL)N((((4((PYRIMIDIN2YLAMINO)SULFONYL)PHENYL)AMINO)THIOXOMETHYL)AMINO)CARBOXAMIDE
1((4METHYL3NITROBENZOYL)AMINO)3(4(PYRIMIDIN2YLSULFAMOYL)PHENYL)THIOUREA
2((4methyl3nitrophenyl)carbonyl)N(4(pyrimidin2ylsulfamoyl)phenyl)hydrazinecarbothioamide
CC1=C(C=C(C=C1)C(=O)NNC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)(N+)(=O)(O)
InChI=1SC19H17N7O5S2c1123413(1116(12)26(28)29)17(27)232419(32)22145715(8614)33(3031)25182092102118h211H1H3(H2327)(H202125)(H2222432)
MFCD05083766
S=C(Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1)NNC(=O)c1ccc(c(c1)(N+)(=O)(O))C
ZINC000002857015
ZINC2857015
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